Geometry & MOs

Info

ID:	13313
PubChem CID:	225354
Reduced:	N5C11H17 (1)
Stoich.:	A5B11C17 (1)
Weight, g/mol:	219.148396
ΔH_f, kcal/mol:	41.9
Dipole, Da:	2.07
IP(EA), eV:	-8.68(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-9-ethylpurin-6-amine

Drug info:

PubChemData

Smile

CCCCNC1=C2C(=NC=N1)N(C=N2)CC

DOS

IR

Vibrations